Vitas-M small molecule compound
(2R,3R,10bS)-3-[(4-methoxyphenyl)carbonyl]-2-(thiophen-2-yl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Catalog ID
STK526768
SMILES N#CC1(C#N)[C@@H](c2cccs2)[C@@H](N2[C@H]1c1ccccc1C=C2)C(=O)c1ccc(cc1)OC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H19N3O2S MW 437.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N3O2S/c1-31-19-10-8-18(9-11-19)24(30)23-22(21-7-4-14-32-21)26(15-27,16-28)25-20-6-3-2-5-17(20)12-13-29(23)25/h2-14,22-23,25H,1H3/t22-,23+,25-/m0/s1InChIKey
YMCXLLPIHSKVQS-ARNLJNQMSA-NSynonyms
303740-71-8(2R3R10bS)3((4methoxyphenyl)carbonyl)2(thiophen2yl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
(2R3R10bS)3(4methoxybenzoyl)2(thiophen2yl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
(2R3R10BS)3(4METHOXYBENZOYL)2THIOPHEN2YL310BDIHYDRO2HPYRROLO(21A)ISOQUINOLINE11DICARBONITRILE
3(4METHOXYBENZOYL)2(2THIENYL)23DIHYDROPYRROLO(21A)ISOQUINOLINE11(10BH)DICARBONITRILE
303740718
COC1=CC=C(C=C1)C(=O)C2C(C(C3N2C=CC4=CC=CC=C34)(C#N)C#N)C5=CC=CS5
InChI=1SC26H19N3O2Sc1311910818(91119)24(30)2322(2174143221)26(15271628)2520632517(20)121329(23)25h214222325H1H3t2223+25m0s1
N#CC1(C#N)(C@@H)(c2cccs2)(C@@H)(N2(C@H)1c1ccccc1C=C2)C(=O)c1ccc(cc1)OC
ZINC000019816560
ZINC19816560
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.